#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmq h LYS 2 N 0.00 0.00 -4.79 1.97 2.10 -2.09 -3.43 116.57 110.33 2kmq h LYS 2 Ca 0.00 0.00 -0.57 0.00 -2.00 0.00 0.00 60.65 58.08 2kmq h LYS 2 Cb 0.00 0.00 -0.33 0.00 -0.90 0.00 0.00 32.23 31.00 2kmq h LYS 2 CO 0.00 0.00 -0.83 0.54 -2.00 0.00 0.00 179.45 177.16 2kmq s VAL 3 N -3.30 1.43 0.24 0.07 0.11 -1.26 -5.09 120.40 112.59 2kmq s VAL 3 Ca 0.06 -0.65 -0.30 0.00 -2.93 0.00 0.00 61.98 58.16 2kmq s VAL 3 Cb 0.10 -1.27 -0.09 0.00 -1.53 0.00 0.00 36.38 33.58 2kmq s VAL 3 CO 0.48 0.42 1.34 0.00 -3.33 0.00 0.00 175.10 174.01 2kmq s ALA 5 N -0.23 3.22 0.67 0.00 0.00 -1.26 -5.04 121.76 119.13 2kmq s ALA 5 Ca 0.55 0.42 -0.17 0.00 0.00 0.00 0.00 51.96 52.77 2kmq s ALA 5 Cb -0.38 -3.10 0.01 0.00 0.00 0.00 0.00 23.12 19.64 2kmq s ALA 5 CO 0.43 0.20 1.22 0.00 0.00 0.00 0.00 175.76 177.60 2kmq s PRO 7 N -3.65 -0.88 0.00 0.00 0.04 -1.26 -5.02 135.00 124.23 2kmq s PRO 7 Ca 0.76 -0.22 0.24 0.00 0.04 0.00 0.00 61.00 61.82 2kmq s PRO 7 Cb -0.31 -1.65 0.30 0.00 0.04 0.00 0.00 34.50 32.89 2kmq s PRO 7 CO 0.40 -3.46 1.27 1.63 0.04 0.00 0.00 177.00 176.89 2kmq n LYS 8 N -4.55 0.55 -1.44 4.56 4.76 -1.26 -4.96 118.16 115.82 2kmq n LYS 8 Ca 0.15 -0.39 -0.33 0.00 -2.87 0.00 0.00 58.31 54.87 2kmq n LYS 8 Cb 0.60 -1.49 0.09 0.00 -1.84 0.00 0.00 35.03 32.38 2kmq n LYS 8 CO 0.00 0.00 0.00 -1.50 -1.37 0.00 0.00 177.40 174.53 2kmq s ILE 9 N -2.72 2.76 -0.75 -0.18 2.07 -1.26 -5.02 121.20 116.10 2kmq s ILE 9 Ca 0.16 0.33 0.04 0.00 -1.41 0.00 0.00 60.65 59.77 2kmq s ILE 9 Cb 0.18 -2.80 0.26 0.00 0.13 0.00 0.00 42.46 40.23 2kmq s ILE 9 CO 0.65 -0.24 0.92 -0.11 -1.91 0.00 0.00 174.94 174.25 2kmq n LEU 10 N -2.91 4.40 -2.92 8.50 -0.00 -1.26 -4.85 117.00 117.96 2kmq n LEU 10 Ca 0.11 -5.39 -0.14 0.00 -0.00 0.00 0.00 56.01 50.60 2kmq n LEU 10 Cb 0.51 -0.82 0.01 0.00 -0.00 0.00 0.00 43.42 43.13 2kmq n LEU 10 CO 0.49 1.96 0.03 1.17 -0.00 0.00 0.00 177.39 181.04 2kmq n LYS 11 N 0.99 0.82 -0.94 1.96 4.81 -1.26 -5.16 118.16 119.38 2kmq n LYS 11 Ca 0.29 -2.38 -0.30 0.00 -0.87 0.00 0.00 58.31 55.05 2kmq n LYS 11 Cb 0.39 -1.35 0.17 0.00 0.02 0.00 0.00 35.03 34.26 2kmq n LYS 11 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2kmq s PRO 12 N -0.27 0.67 0.24 1.64 0.04 -1.25 -4.63 135.00 131.45 2kmq s PRO 12 Ca 0.32 0.98 -0.01 0.00 0.04 0.00 0.00 61.00 62.33 2kmq s PRO 12 Cb 0.24 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 33.02 2kmq s PRO 12 CO -0.16 -2.69 0.22 0.14 0.04 0.00 0.00 177.00 174.56 2kmq s VAL 13 N -2.76 0.00 -0.25 -0.36 -7.23 0.21 -2.31 120.40 107.70 2kmq s VAL 13 Ca 0.65 -1.90 -0.03 0.00 -1.81 0.00 0.00 61.98 58.89 2kmq s VAL 13 Cb -0.21 -2.47 0.01 0.00 0.56 0.00 0.00 36.38 34.27 2kmq s VAL 13 CO 0.59 0.00 -0.03 0.00 -0.31 0.00 0.00 175.10 175.35 2kmq s GLY 15 N 1.41 1.58 0.00 0.00 0.00 -0.54 -2.06 107.32 107.71 2kmq s GLY 15 Ca 0.03 -0.32 0.28 0.00 0.00 0.00 0.00 44.72 44.71 2kmq s GLY 15 CO -0.03 0.25 1.95 -1.26 0.00 0.00 0.00 173.10 174.02 2kmq n SER 16 N -4.03 0.00 0.05 1.64 2.88 0.11 -1.96 113.62 112.31 2kmq n SER 16 Ca 0.06 0.06 0.13 0.00 -1.33 0.00 0.00 58.87 57.78 2kmq n SER 16 Cb 0.57 -0.35 0.34 0.00 -0.75 0.00 0.00 64.21 64.02 2kmq n SER 16 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2kmq n ASP 17 N -1.35 0.57 0.00 -3.46 2.03 -1.26 -4.97 116.55 108.11 2kmq n ASP 17 Ca 0.11 0.26 0.00 0.00 0.52 0.00 0.00 54.79 55.69 2kmq n ASP 17 Cb 0.25 -0.23 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 2kmq n ASP 17 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kmq n GLY 18 N 1.39 1.18 3.33 0.27 0.00 -0.83 -5.10 105.19 105.43 2kmq n GLY 18 Ca 0.05 -0.41 -0.23 0.00 0.00 0.00 0.00 46.02 45.43 2kmq n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2kmq s ARG 19 N -2.01 1.27 0.24 1.61 6.06 -1.26 -4.97 118.95 119.90 2kmq s ARG 19 Ca 0.00 -1.36 -0.28 0.00 -2.50 0.00 0.00 55.73 51.58 2kmq s ARG 19 Cb 0.00 -1.42 -0.09 0.00 0.06 0.00 0.00 34.95 33.50 2kmq s ARG 19 CO 0.00 0.30 0.91 0.99 -2.50 0.00 0.00 175.30 175.01 2kmq s THR 20 N -1.77 4.15 0.01 4.11 2.01 -1.26 -1.47 115.64 121.42 2kmq s THR 20 Ca 0.14 1.97 0.03 0.00 0.31 0.00 0.00 61.69 64.15 2kmq s THR 20 Cb -0.07 -4.24 -0.01 0.00 0.01 0.00 0.00 72.50 68.19 2kmq s THR 20 CO 0.06 0.44 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.02 2kmq s TYR 21 N -1.26 0.88 0.44 4.92 2.02 -0.31 -4.94 117.35 119.10 2kmq s TYR 21 Ca 0.42 -0.25 0.33 0.00 -0.37 0.00 0.00 57.07 57.20 2kmq s TYR 21 Cb -0.24 -0.54 1.73 0.00 -0.40 0.00 0.00 41.96 42.50 2kmq s TYR 21 CO 0.30 -0.01 2.15 0.00 -1.57 0.00 0.00 175.55 176.42 2kmq h ALA 22 N 5.46 1.18 -2.88 3.71 0.00 -1.91 0.62 119.26 125.44 2kmq h ALA 22 Ca -0.33 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2kmq h ALA 22 Cb 1.18 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.87 2kmq h ALA 22 CO 0.47 0.07 0.04 1.21 0.00 0.00 0.00 179.25 181.04 2kmq s ASN 23 N -5.82 -0.26 0.49 0.00 2.47 -1.26 -3.76 114.94 106.79 2kmq s ASN 23 Ca -0.03 -0.50 0.27 0.00 0.42 0.00 0.00 52.86 53.02 2kmq s ASN 23 Cb 0.13 0.59 1.35 0.00 -1.45 0.00 0.00 41.25 41.86 2kmq s ASN 23 CO 0.53 -1.08 1.83 -1.28 -3.72 0.00 0.00 177.10 173.38 2kmq h SER 24 N 2.18 0.17 -0.42 -4.21 0.87 -1.93 -2.43 113.55 107.79 2kmq h SER 24 Ca -0.28 0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.35 2kmq h SER 24 Cb 1.26 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.20 2kmq h SER 24 CO 0.36 0.05 0.28 0.00 -0.53 0.00 0.00 176.83 176.99 2kmq h ILE 26 N 0.40 1.06 -0.83 0.00 1.08 -1.82 -3.11 117.51 114.30 2kmq h ILE 26 Ca 0.17 -2.42 0.15 0.00 -0.39 0.00 0.00 64.86 62.37 2kmq h ILE 26 Cb 0.19 2.75 -0.10 0.00 -3.07 0.00 0.00 36.82 36.60 2kmq h ILE 26 CO -0.04 0.72 0.40 0.00 -0.69 0.00 0.00 178.15 178.54 2kmq h ALA 27 N -0.02 1.23 -0.25 1.87 0.00 -1.59 -2.02 119.26 118.48 2kmq h ALA 27 Ca -0.30 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 2kmq h ALA 27 Cb 1.78 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.57 2kmq h ALA 27 CO 0.08 -0.13 -0.25 0.00 0.00 0.00 0.00 179.25 178.95 2kmq h ARG 28 N 0.57 0.48 0.00 0.00 3.08 -1.43 -1.05 114.38 116.03 2kmq h ARG 28 Ca 0.46 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.33 2kmq h ARG 28 Cb 0.66 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.68 2kmq h ARG 28 CO -0.38 0.69 0.00 0.00 -1.07 0.00 0.00 179.97 179.22 2kmq n ASN 30 N -2.42 2.88 0.00 0.00 3.02 -0.76 -4.88 115.26 113.11 2kmq n ASN 30 Ca 0.00 -1.87 0.00 0.00 -0.03 0.00 0.00 54.58 52.69 2kmq n ASN 30 Cb 0.17 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 2kmq n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kmq n GLY 31 N 1.17 0.70 3.87 7.41 0.00 -0.83 -5.05 105.19 112.46 2kmq n GLY 31 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 2kmq n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kmq s VAL 32 N -2.86 4.73 0.20 1.61 1.01 -0.47 -4.96 120.40 119.65 2kmq s VAL 32 Ca 0.00 0.76 0.09 0.00 0.00 0.00 0.00 61.98 62.83 2kmq s VAL 32 Cb 0.00 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 2kmq s VAL 32 CO 0.00 -0.93 -0.11 -0.94 0.00 0.00 0.00 175.10 173.12 2kmq s SER 33 N -3.86 4.14 0.29 3.32 1.04 -1.26 -3.09 113.70 114.29 2kmq s SER 33 Ca 0.54 -0.65 -0.29 0.00 0.48 0.00 0.00 55.95 56.03 2kmq s SER 33 Cb -0.11 -0.65 -0.10 0.00 0.10 0.00 0.00 66.02 65.27 2kmq s SER 33 CO 0.46 0.09 1.21 -0.51 0.98 0.00 0.00 173.24 175.47 2kmq s ILE 34 N -1.80 3.14 0.14 -1.02 -1.16 -1.26 0.09 121.20 119.33 2kmq s ILE 34 Ca 0.25 1.12 0.00 0.00 -0.51 0.00 0.00 60.65 61.51 2kmq s ILE 34 Cb -0.08 -3.71 0.00 0.00 0.61 0.00 0.00 42.46 39.28 2kmq s ILE 34 CO 0.15 0.26 0.00 1.17 -2.81 0.00 0.00 174.94 173.71 2kmq n LYS 35 N 1.19 0.00 -4.31 3.50 0.00 -0.94 -4.74 118.16 112.86 2kmq n LYS 35 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 58.31 58.15 2kmq n LYS 35 Cb 0.43 -0.38 -0.10 0.00 0.00 0.00 0.00 35.03 34.98 2kmq n LYS 35 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2kmq s SER 36 N -5.73 1.55 0.39 3.14 0.15 -0.87 -5.05 113.70 107.28 2kmq s SER 36 Ca 0.00 -1.25 0.02 0.00 0.70 0.00 0.00 55.95 55.42 2kmq s SER 36 Cb 0.00 0.07 -0.01 0.00 -1.71 0.00 0.00 66.02 64.36 2kmq s SER 36 CO 0.00 -0.58 0.58 -1.61 1.20 0.00 0.00 173.24 172.83 2kmq s GLU 37 N -3.91 3.22 0.32 5.44 2.02 -1.26 -0.79 118.70 123.74 2kmq s GLU 37 Ca 0.30 -0.55 0.00 0.00 0.02 0.00 0.00 54.97 54.74 2kmq s GLU 37 Cb 0.06 -2.65 0.00 0.00 0.10 0.00 0.00 34.13 31.64 2kmq s GLU 37 CO 0.09 -0.05 0.00 0.41 0.02 0.00 0.00 175.26 175.73 2kmq n GLY 38 N -1.88 -2.68 3.69 -1.39 0.00 -0.98 -4.56 105.19 97.39 2kmq n GLY 38 Ca -0.01 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 2kmq n GLY 38 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2kmq n SER 39 N -3.48 4.08 -4.75 1.61 3.41 -1.23 -2.70 113.62 110.55 2kmq n SER 39 Ca -0.04 0.97 -0.40 0.00 -0.26 0.00 0.00 58.87 59.15 2kmq n SER 39 Cb 0.40 -1.54 -0.06 0.00 -0.26 0.00 0.00 64.21 62.75 2kmq n SER 39 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kmq n PRO 41 N 1.33 -2.51 -2.89 0.00 -0.04 -1.26 -4.45 135.00 125.18 2kmq n PRO 41 Ca -0.01 -1.23 -0.11 0.00 -0.04 0.00 0.00 63.50 62.11 2kmq n PRO 41 Cb 0.47 -1.15 0.06 0.00 -0.04 0.00 0.00 33.50 32.83 2kmq n PRO 41 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2kmq n THR 42 N -4.16 -3.67 0.00 0.52 -1.04 -1.26 -4.72 114.28 99.95 2kmq n THR 42 Ca 0.11 -0.30 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 2kmq n THR 42 Cb 0.41 -4.03 0.00 0.00 -1.82 0.00 0.00 70.33 64.90 2kmq n THR 42 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kmq n GLY 43 N -1.09 -0.29 0.00 3.41 0.00 -1.26 -5.08 105.19 100.88 2kmq n GLY 43 Ca -0.18 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.85 2kmq n GLY 43 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71